TL;DR: 2-Chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde (CAS 108035-77-4) is a chemical compound with molecular formula C11H9ClO4 and molecular weight 240.01894 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde
Also Known As: 1,3,5-triformyl-2-chloro-6-ethoxybenzene, 2-chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde, 2-chloro-4-ethoxy-benzene-1,3,5-tricarbaldehyde
| Molecular Formula | C11H9ClO4 |
| Molecular Weight | 240.01894 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.01894 Da |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
| SMILES | CCOC1=C(C(=C(C=C1C=O)C=O)Cl)C=O |
| InChIKey | CZYWRGKYZCFFAZ-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde. Following Lipinski's Rule of Five, 2-Chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde is 108035-77-4.
The molecular formula of 2-Chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde is C11H9ClO4.
The molecular weight of 2-Chloro-4-ethoxybenzene-1,3,5-tricarbaldehyde is 240.01894 g/mol.
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